Vitas-M small molecule compound

[5-(phenoxymethyl)-4H-1,2,4-triazol-3-yl]acetic acid

Catalog ID
STK939849
SMILES OC(=O)Cc1nnc([nH]1)COc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C11H11N3O3 MW 233.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H11N3O3/c15-11(16)6-9-12-10(14-13-9)7-17-8-4-2-1-3-5-8/h1-5H,6-7H2,(H,15,16)(H,12,13,14)
InChIKey
RKDURUPUGVBJDS-UHFFFAOYSA-N
Synonyms
1216294-22-2
(5(phenoxymethyl)4H124triazol3yl)aceticacid
(5PHENOXYMETHYL2H(124)TRIAZOL3YL)ACETICACID
1216294222
2(3(PHENOXYMETHYL)1H124TRIAZOL5YL)ACETICACID
2(5(phenoxymethyl)1H124triazol3yl)aceticacid
C1=CC=C(C=C1)OCC2=NC(=NN2)CC(=O)O
InChI=1SC11H11N3O3c1511(16)691210(14139)7178421358h15H67H2(H1516)(H121314)
MFCD18179371
OC(=O)Cc1(nH)nc(n1)COc1ccccc1
OC(=O)Cc1nnc((nH)1)COc1ccccc1
ZINC000040162978
ZINC40162978

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Available files

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